N-(3-azanyl-3-azanylidene-propyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-1-isopentyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-1-(3-methylbutyl)-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-1-(3-methylbutyl)-4-nitropyrrole-2-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-1-isoamyl-4-nitro-pyrrole-2-carboxamide Formula: C13H21N5O3 MolecularWeight: 295.33754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C=C1C(=O)NCCC(=N)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C=C(C=C1C(=O)NCCC(=N)N)[N+](=O)[O-]

InChI

InChI=1S/C13H21N5O3/c1-9(2)4-6-17-8-10(18(20)21)7-11(17)13(19)16-5-3-12(14)15/h7-9H,3-6H2,1-2H3,(H3,14,15)(H,16,19)